PUBCHEM-ZINC04760631 MOE2007 3D CORINA 3.40 0006 02.08.2006 47 47 0 0 1 0 0 0 0 0999 V2000 -0.0190 1.5260 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 C 0 0 3 0 0 0 0 0 0 0 0 0 0.5120 -0.3560 -0.8950 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7310 -0.5030 1.2230 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1590 -1.2130 2.0230 O 0 0 0 0 0 0 0 0 0 0 0 0 2.0190 -0.1610 1.4260 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.3720 -0.5110 0.0120 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.0510 -0.6430 -1.1450 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5240 -0.3410 -2.1940 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.4650 -1.1640 -1.1340 C 0 0 3 0 0 0 0 0 0 0 0 0 -4.0910 -0.5030 -0.5350 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4850 -2.5710 -0.5320 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.9320 -3.0510 -0.4060 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.9560 -4.7180 0.3080 S 0 0 0 0 0 0 0 0 0 0 0 0 -6.7260 -5.1070 0.3770 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9780 -1.2130 -2.5050 N 0 0 0 0 0 0 0 0 0 0 0 0 -5.3050 -1.1510 -2.7310 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.0760 -1.0540 -1.7970 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.7760 -1.1950 -3.9910 O 0 0 0 0 0 0 0 0 0 0 0 0 -7.2170 -1.1230 -4.1590 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.5550 -1.1870 -5.6260 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.7780 -2.4100 -6.2320 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.0880 -2.4690 -7.5770 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.1770 -1.3050 -8.3180 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.9540 -0.0820 -7.7120 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.6480 -0.0230 -6.3660 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0040 1.9030 0.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5460 1.8870 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5290 1.8770 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4760 0.4060 0.7860 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4880 -0.4830 2.2120 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7940 -0.7520 0.8520 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9310 -3.2510 -1.1790 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0220 -2.5500 0.4550 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4860 -2.3700 0.2420 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3950 -3.0710 -1.3920 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.2350 -4.3750 1.0050 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.1450 -5.0760 -0.6290 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.8640 -6.1040 0.7970 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3620 -1.2900 -3.2510 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.6850 -1.9600 -3.6420 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.5850 -0.1860 -3.7420 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.7090 -3.3190 -5.6530 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.2620 -3.4240 -8.0500 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.4180 -1.3510 -9.3690 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.0230 0.8280 -8.2910 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.4780 0.9330 -5.8920 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 27 1 0 0 0 0 1 28 1 0 0 0 0 1 29 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 7 1 0 0 0 0 4 5 2 0 0 0 0 4 6 1 0 0 0 0 6 30 1 0 0 0 0 6 31 1 0 0 0 0 7 8 1 0 0 0 0 7 32 1 0 0 0 0 8 9 2 0 0 0 0 8 10 1 0 0 0 0 10 11 1 0 0 0 0 10 12 1 0 0 0 0 10 16 1 0 0 0 0 12 13 1 0 0 0 0 12 33 1 0 0 0 0 12 34 1 0 0 0 0 13 14 1 0 0 0 0 13 35 1 0 0 0 0 13 36 1 0 0 0 0 14 15 1 0 0 0 0 15 37 1 0 0 0 0 15 38 1 0 0 0 0 15 39 1 0 0 0 0 16 17 1 0 0 0 0 16 40 1 0 0 0 0 17 18 2 0 0 0 0 17 19 1 0 0 0 0 19 20 1 0 0 0 0 20 21 1 0 0 0 0 20 41 1 0 0 0 0 20 42 1 0 0 0 0 21 22 1 0 0 0 0 21 26 2 0 0 0 0 22 23 2 0 0 0 0 22 43 1 0 0 0 0 23 24 1 0 0 0 0 23 44 1 0 0 0 0 24 25 2 0 0 0 0 24 45 1 0 0 0 0 25 26 1 0 0 0 0 25 46 1 0 0 0 0 26 47 1 0 0 0 0 M END